Geometry & MOs

Info

ID:	226515
PubChem CID:	87457738
Reduced:	BrO2S2N5C21H22 (1)
Stoich.:	AB2C2D5E21F22 (1)
Weight, g/mol:	219.125929
ΔH_f, kcal/mol:	49.32
Dipole, Da:	6.35
IP(EA), eV:	-8.62(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxy-4,4-dimethyl-2,3-dihydronaphthalen-1-ylidene)hydroxylamine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)/N=[S@@](\C)/C2=CC=CC(=C2)NC3=NC=C(C(=N3)NC4CC4)Br

DOS

IR

Vibrations